orbital_charges     :real:2:4,11
  0.123992852936336E+001  0.957598728168482E+000  0.869621445618515E+000
  0.985769216817051E+000  0.126177540039026E+001  0.960721542641682E+000
  0.966230027401686E+000  0.100431152570117E+001  0.124284903444192E+001
  0.960443532186591E+000  0.870553752275966E+000  0.991087761206933E+000
  0.153581789542717E+001  0.116258013439031E+001  0.138559205991791E+001
  0.102915862295111E+001  0.153628243968265E+001  0.116321679139749E+001
  0.138635727936555E+001  0.103282483397534E+001  0.915572097893004E+000
  0.000000000000000E+000  0.000000000000000E+000  0.000000000000000E+000
  0.911143490369145E+000  0.000000000000000E+000  0.000000000000000E+000
  0.000000000000000E+000  0.910162261798506E+000  0.000000000000000E+000
  0.000000000000000E+000  0.000000000000000E+000  0.905112278578981E+000
  0.000000000000000E+000  0.000000000000000E+000  0.000000000000000E+000
  0.911073879195337E+000  0.000000000000000E+000  0.000000000000000E+000
  0.000000000000000E+000  0.904215438843903E+000  0.000000000000000E+000
  0.000000000000000E+000  0.000000000000000E+000
forces              :real:2:3,11
  0.304803079146833E-003 -0.740164846396024E-003 -0.108061860639324E-002
  0.430323496474802E-003  0.100192924753719E-003  0.802313875541357E-002
 -0.567576957961590E-003  0.309012510378362E-004 -0.106512942706699E-002
  0.105834947467792E-003 -0.332596743580820E-001  0.287979137165408E-002
 -0.869008745194192E-004  0.334614583242062E-001  0.262156088160123E-002
 -0.218751445964840E-002  0.165907115272394E-002 -0.257998162712473E-002
  0.192632997639341E-002  0.146623150911206E-002 -0.256352467015048E-002
 -0.563414105364396E-003  0.136406609291508E-005 -0.607882722983087E-003
  0.234926979228334E-003  0.406950900780470E-004 -0.371787885715784E-003
  0.199013367132671E-002 -0.147188248066547E-002 -0.268191162163385E-002
 -0.158694575254412E-002 -0.128819263286131E-002 -0.257365444760076E-002
mermin_energy       :real:0:
 -0.121373299995783E+002
end_coords          :real:2:3,11
  0.000000000000000E+000  0.225925718133056E+001  0.300756694095895E+000
  0.000000000000000E+000  0.000000000000000E+000 -0.152977684042497E+001
  0.000000000000000E+000 -0.225925718133056E+001  0.300756694095895E+000
  0.000000000000000E+000 -0.116172927154697E+001  0.290220243387674E+001
  0.000000000000000E+000  0.116172927154697E+001  0.290220243387674E+001
 -0.166109578909731E+001  0.347381185316227E+001  0.152237081530314E+000
  0.166109578909731E+001  0.347381185316227E+001  0.152237081530314E+000
 -0.166318828268447E+001  0.000000000000000E+000 -0.274254477633448E+001
  0.166318828268447E+001  0.000000000000000E+000 -0.274254477633448E+001
  0.166109578909731E+001 -0.347381185316227E+001  0.152237081530314E+000
 -0.166109578909731E+001 -0.347381185316227E+001  0.152237081530314E+000
